1-adamantyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[[(2,4-dimethylanilino)-oxomethyl]amino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-keto-ethyl]ammonium Formula: C21H30N3O2+ MolecularWeight: 356.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C21H29N3O2/c1-13-3-4-18(14(2)5-13)23-20(26)24-19(25)12-22-21-9-15-6-16(10-21)8-17(7-15)11-21/h3-5,15-17,22H,6-12H2,1-2H3,(H2,23,24,25,26)/p+1